SCHEMBL218397

SCHEMBL218397

[O]CC1c2ccccc2-c2ccccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.58
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
FABP7 O15540 2/20 0.41
FABP5 Q01469 2/20 0.41
GPR3 P46089 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
NCOR2 Q9Y618 1/20 0.40
TSHR P16473 2/20 0.40
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP1A2 P05177 1/20 0.38
TDO2 P48775 1/20 0.38
CHRM2 P08172 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1567175 0.80 HTR2A (0.54) HTR2ACA1CA2FABP7FABP5
SCHEMBL4910851 0.79 HTR2A (0.58) HTR2ACA1CA2GPR3HDAC3
SCHEMBL7576966 0.78 HTR2A (0.64) HTR2ACA1CA2GPR3HDAC3
SCHEMBL5353138 0.78 HTR2A (0.64) HTR2ACA1CA2GPR3KMT2A
SCHEMBL7574105 0.76 HTR2A (0.61) HTR2ACA1CA2GPR3KMT2A
SCHEMBL17022715 0.76 HTR2A (0.61) HTR2ACA1CA2GPR3KMT2A
SCHEMBL2286468 0.74 HTR2A (0.58) HTR2ACA1CA2FABP7FABP5
SCHEMBL499897 0.74 HTR2A (0.58) HTR2ACA1CA2GPR3HDAC3
SCHEMBL22664654 0.74 HTR2A (0.58) HTR2ACA1CA2GPR3TSHR
SCHEMBL633764 0.74 HTR2A (0.58) HTR2ACA1CA2GPR3POLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1752 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117924154-A Preparation method of piperidine-2-formate compound 浙江九洲药业股份有限公司 2024-04-26 CN claimed
CN-117285598-B Nano peptide F3FT for resisting intracellular gram positive bacteria infection, and preparation method and application thereof 东北农业大学 2024-04-09 CN claimed
CN-115368363-B Chiral or racemized pyrimidodiazepinone compound and preparation method and application thereof 中山大学 2024-02-20 CN claimed
CN-116867795-A Novel method for producing antibody-immunostimulant conjugate 第一三共株式会社 2023-10-10 CN claimed
CN-116685576-A Cysteine protease inhibitors and methods of use thereof 美商帕迪斯生物科学公司 2023-09-01 CN claimed
WO-2023136470-A1 PNA MONOMER AND PNA OLIGOMER INCLUDING SAME 주식회사 시선바이오머티리얼스 2023-07-20 WO claimed
US-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF Pardes Biosciences, Inc. 2023-07-06 US claimed
CN-110272544-B Oligomer, composition, article, method for preparing article, and display device 三星电子株式会社 2023-07-04 CN claimed
WO-2023104021-A1 METABOLIC CHECKPOINT-BASED HUMAN SERUM ALBUMIN NANO-DRUG, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 深圳先进技术研究院 2023-06-15 WO claimed
CN-114163354-B Preparation method of N-fluorenylmethoxycarbonyl-N-trityl-L-asparagine 常州吉恩药业有限公司 2023-05-05 CN claimed
EP-0245662-B1 P-HYDROXYPHENYLSULFONIUM SALTS AND THEIR USE IN THE PREPARATION OF ESTERS AND AMIDES SANSHIN KAGAKU KOGYO CO., LTD. (JP) 1991-08-07 EP claimed
US-5021197-A Reacting a p-dialkylsulfoniophenol with a carbonyl halogenide in the presence of a secondary amine MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1991-06-04 US claimed
US-4990644-A Water solubility SANSHIN KAGAKU KOGYO CO. LTD. (JP) 1991-02-05 US claimed
EP-0406567-A2 Process for the production of sulfonium compounds and novel methylthiophenol derivatives MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1991-01-09 EP claimed
EP-0393893-A1 Sulfonium compound and polymerisation initator comprising the sulfonium compound as the main ingredient SANSHIN KAGAKU KOGYO CO., LTD. (JP) 1990-10-24 EP claimed
EP-0375047-A2 New process for the synthesis of N alpha-fluorenylmethoxycarbonyl-Ng-trityl-arginine SCLAVO S.p.A. (IT) 1990-06-27 EP claimed
EP-0346756-A1 Process for production of sulfonium compounds MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1989-12-20 EP claimed
EP-0331988-A1 Sulfonium compounds, as well as process for producing active esters and amides used for the production of amides SANSHIN KAGAKU KOGYO CO., LTD. (JP) 1989-09-13 EP claimed
US-4857656-A Active esters used for production of esters or amides and process for producing esters or amides SANSHIN KAGAKU KOGYO CO., LTD. (JP) 1989-08-15 US claimed
EP-0245662-A1 p-Hydroxyphenylsulfonium salts and their use in the preparation of esters and amides SANSHIN KAGAKU KOGYO CO., LTD. (JP) 1987-11-19 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230212152-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF CTRL, CTSL, CTSV HTR2A 3835/4885CA1 545/4885CA2 607/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.